3-bromo-N-[(1Z)-1-(3,4-dimethoxyphenyl)-3-oxo-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)prop-1-en-2-yl]benzamide

Chemical Structure Depiction of
3-bromo-N-[(1Z)-1-(3,4-dimethoxyphenyl)-3-oxo-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)prop-1-en-2-yl]benzamide
Available: 262 mg
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mg
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Compound characteristics

Compound ID: K617-0137
Compound Name: 3-bromo-N-[(1Z)-1-(3,4-dimethoxyphenyl)-3-oxo-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)prop-1-en-2-yl]benzamide
Molecular Weight: 578.46
Molecular Formula: C29 H28 Br N3 O5
Smiles: COc1ccc(/C=C(/C(N2CC3CC(C2)C2=CC=CC(N2C3)=O)=O)NC(c2cccc(c2)[Br])=O)cc1OC
Stereo: MIXTURE OF STEREOISOMERS
logP: 4.3172
logD: 1.9317
logSw: -4.4952
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 69.771
InChI Key: WMIOLZHXVYHYJF-UHFFFAOYSA-N
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